| People | Locations | Statistics |
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| Naji, M. |
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| Motta, Antonella |
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| Aletan, Dirar |
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| Mohamed, Tarek |
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| Ertürk, Emre |
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| Taccardi, Nicola |
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| Kononenko, Denys |
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| Petrov, R. H. | Madrid |
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| Alshaaer, Mazen | Brussels |
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| Bih, L. |
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| Casati, R. |
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| Muller, Hermance |
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| Kočí, Jan | Prague |
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| Šuljagić, Marija |
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| Kalteremidou, Kalliopi-Artemi | Brussels |
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| Azam, Siraj |
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| Ospanova, Alyiya |
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| Blanpain, Bart |
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| Ali, M. A. |
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| Popa, V. |
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| Rančić, M. |
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| Ollier, Nadège |
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| Azevedo, Nuno Monteiro |
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| Landes, Michael |
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| Rignanese, Gian-Marco |
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Stipp, S. L. S.
Technical University of Denmark
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (9/9 displayed)
- 2023Prediction of the surface chemistry of calcium aluminosilicate glassescitations
- 2023Prediction of the surface chemistry of calcium aluminosilicate glassescitations
- 2022Order and Disorder in Layered Double Hydroxides: Lessons Learned from the Green Rust Sulfate-Nikischerite Seriescitations
- 2022Surface evolution of aluminosilicate glass fibers during dissolution:influence of pH, solid-to-solution ratio and organic treatmentcitations
- 2022Surface evolution of aluminosilicate glass fibers during dissolution: Influence of pH, solid-to-solution ratio and organic treatmentcitations
- 2021Predicted structures of calcium aluminosilicate glass as a model for stone wool fibercitations
- 2021Wettability and hydrolytic stability of 3-aminopropylsilane coupling agent and phenol-urea-formaldehyde binder on silicate surfaces and fiberscitations
- 2020Surface Reactivity and Dissolution Properties of Alumina-Silica Glasses and Fiberscitations
- 2014Biomineralizationcitations
Places of action
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article
Predicted structures of calcium aluminosilicate glass as a model for stone wool fiber
Abstract
<p>Characterization of compositionally-complex aluminosilicate glass particles and fibers such as stone wool, and their interfaces with water and ions, is significant to a range of areas regarding dissolution phenomena. Knowledge of atomic level structures of these interfaces is critical to elucidating their dissolution traits. Molecular simulations can provide these details, complementing experimental efforts. However, prediction of the structure of stone wool fiber has been hampered by a lack of suitable inter-atomic potentials. Here, two candidate potentials are evaluated for their ability to recover experimental structural data of calcium aluminosilicate (CaO-Al<sub>2</sub>O<sub>3</sub>-SiO<sub>2</sub>) glass of compositions relevant to stone wool fibers. Both potentials produce structures that are broadly consistent with experimental data, including defect concentrations, aluminium avoidance, and ring size distributions, and either could provide a suitable basis for modelling dissolution of these materials.</p>